SCHEMBL937376

SCHEMBL937376

CC(O)c1ccc(Nc2nccc(-c3cc(C(=O)N4CCCCC4)cs3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 12/20 0.56
CHUK O15111 12/20 0.56
IKBKG Q9Y6K9 12/20 0.56
MTOR P42345 1/20 0.50
SMG1 Q96Q15 1/20 0.50
MEN1 O00255 1/20 0.49
RECQL P46063 1/20 0.49
BLM P54132 1/20 0.49
KMT2A Q03164 1/20 0.49
PRKCZ Q05513 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CDK1 P06493 1/20 0.45
CDK2 P24941 1/20 0.45
SYK P43405 2/20 0.42
JAK2 O60674 1/20 0.42
BTK Q06187 2/20 0.42
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
BLK P51451 1/20 0.42
ITK Q08881 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL938293 0.99 IKBKB (0.57) IKBKBCHUKIKBKGMTORSMG1
SCHEMBL938750 0.91 PLK4 (0.50) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL12423734 0.90 IKBKB (0.51) IKBKBCHUKIKBKGMTORSMG1
SCHEMBL937691 0.90 DYRK2 (0.48) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL12423731 0.89 IKBKB (0.52) IKBKBCHUKIKBKGMTORSMG1
SCHEMBL12423729 0.82 CDK1 (0.55) IKBKBCHUKIKBKGMTORSMG1
SCHEMBL12423736 0.81 SYK (0.48) IKBKBCHUKIKBKGMEN1RECQL
SCHEMBL12423716 0.74 STK17A (0.46) IKBKBPRKCZJAK2SRCNEK3
SCHEMBL12423714 0.73 CAMK2D (0.52) IKBKBPRKCZCDK1CDK2JAK2
SCHEMBL12423725 0.72 CAMK2D (0.44) IKBKBCDK2SYKSRC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US claimed
EP-2283004-B1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE UNIV EDINBURGH (GB) 2015-05-27 EP disclosed
EP-2283004-B1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE UNIV EDINBURGH (GB) 2015-05-27 EP disclosed
US-8614209-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2013-12-24 US disclosed
US-20130012545-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2013-01-10 US disclosed
US-20130012545-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2013-01-10 US disclosed
US-8299063-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2012-10-30 US disclosed
US-8299063-B2 Amido-thiophene compounds and their use THE UNIVERSITY OF EDINBURGH (GB) 2012-10-30 US disclosed
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US disclosed
US-20110015178-A1 Amido-Thiophene Compounds and Their Use THE UNIVERSITY OF EDINBURGH (GB) 2011-01-20 US disclosed
WO-2009112845-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE THE UNIVERSITY OF EDINBURGH (GB) 2009-09-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110015178-A1 Amido-Thiophene Compounds and Their Use HSD11B1, HSD11B2, HSD17B1 IKBKB 1045/4885CHUK 1080/4885IKBKG 1567/4885
US-20130012545-A1 Amido-Thiophene Compounds and Their Use HSD11B1, HSD11B2, HSD17B1 IKBKB 1045/4885CHUK 1080/4885IKBKG 1567/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.